==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 13-APR-07 2YVO . COMPND 2 MOLECULE: MUTT/NUDIX FAMILY PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR T.WAKAMATSU,N.NAKAGAWA,S.KURAMITSU,S.YOKOYAMA,R.MASUI,RIKEN . 182 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10607.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 123 67.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 5.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 46 25.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 18 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 10 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 32 17.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 2 1 2 0 1 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A M 0 0 238 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 28.5 9.0 34.1 95.1 2 2 A S - 0 0 94 1,-0.2 0, 0.0 2,-0.1 0, 0.0 -0.298 360.0-141.8 -59.5 136.3 11.7 35.4 92.8 3 3 A P S S+ 0 0 103 0, 0.0 2,-0.4 0, 0.0 -1,-0.2 0.705 87.0 60.2 -72.9 -16.8 15.1 35.4 94.4 4 4 A W S S- 0 0 80 22,-0.1 2,-0.4 23,-0.1 22,-0.2 -0.930 76.9-143.4-116.0 137.5 16.0 38.6 92.6 5 5 A E E -A 25 0A 129 20,-2.4 20,-2.5 -2,-0.4 2,-0.2 -0.818 18.8-121.3-102.1 134.6 14.0 41.9 92.9 6 6 A R E +A 24 0A 136 -2,-0.4 18,-0.2 18,-0.2 3,-0.1 -0.515 31.6 170.0 -73.1 133.2 13.4 44.2 90.0 7 7 A I E S- 0 0 65 16,-2.8 2,-0.3 1,-0.3 17,-0.2 0.746 73.9 -14.9-104.4 -51.4 14.8 47.7 90.5 8 8 A L E -A 23 0A 127 15,-1.7 15,-2.8 2,-0.0 2,-0.6 -0.965 55.5-152.4-156.9 135.9 14.2 48.9 86.9 9 9 A L E -A 22 0A 55 -2,-0.3 2,-0.5 13,-0.2 13,-0.2 -0.949 17.8-170.6-113.0 113.8 13.5 47.1 83.6 10 10 A E E -A 21 0A 102 11,-2.7 11,-2.8 -2,-0.6 2,-0.6 -0.884 19.4-135.8-107.9 132.7 14.7 49.0 80.5 11 11 A E E -A 20 0A 96 -2,-0.5 9,-0.3 9,-0.2 3,-0.1 -0.767 20.6-179.5 -85.6 120.6 13.8 48.0 77.0 12 12 A I E S+ 0 0 82 7,-2.4 2,-0.3 -2,-0.6 8,-0.2 0.732 71.8 4.7 -89.3 -26.8 17.0 48.1 74.8 13 13 A L E -A 19 0A 74 6,-1.6 6,-2.2 1,-0.1 -1,-0.3 -0.972 49.4-173.1-156.8 142.1 15.3 47.0 71.6 14 14 A S + 0 0 56 1,-0.4 4,-0.1 -2,-0.3 -1,-0.1 0.723 62.6 69.3-107.2 -33.3 11.7 46.3 70.6 15 15 A E S S+ 0 0 128 2,-0.1 -1,-0.4 1,-0.1 4,-0.1 -0.989 99.8 4.5-147.2 152.6 12.2 45.0 67.1 16 16 A P S S+ 0 0 128 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -1.000 142.7 6.5 -73.6 -8.3 13.2 42.8 65.3 17 17 A V S S- 0 0 62 2,-0.0 2,-0.5 0, 0.0 -2,-0.1 -0.999 78.0-125.1-135.3 134.6 13.9 41.1 68.7 18 18 A R + 0 0 89 -2,-0.4 2,-0.4 20,-0.1 -4,-0.2 -0.701 34.2 176.8 -83.9 130.5 12.8 42.5 72.1 19 19 A L E -A 13 0A 44 -6,-2.2 -7,-2.4 -2,-0.5 -6,-1.6 -0.993 7.7-165.8-134.5 139.6 15.8 42.8 74.5 20 20 A V E -AB 11 36A 0 16,-2.9 16,-2.4 -2,-0.4 2,-0.5 -0.883 16.0-152.0-127.4 157.4 15.8 44.2 78.0 21 21 A K E -AB 10 35A 83 -11,-2.8 -11,-2.7 -2,-0.3 2,-0.5 -0.987 23.7-167.7-125.9 113.8 18.4 45.3 80.5 22 22 A E E -AB 9 34A 20 12,-3.3 12,-3.2 -2,-0.5 2,-0.6 -0.919 16.8-150.2-114.4 127.2 17.2 44.9 84.1 23 23 A R E +AB 8 33A 96 -15,-2.8 -16,-2.8 -2,-0.5 -15,-1.7 -0.814 32.4 175.7 -88.7 125.4 18.8 46.3 87.2 24 24 A V E -AB 6 32A 3 8,-3.0 8,-2.1 -2,-0.6 2,-0.6 -0.900 35.9-125.6-130.3 160.6 18.0 43.8 90.0 25 25 A R E -AB 5 31A 93 -20,-2.5 -20,-2.4 -2,-0.3 6,-0.2 -0.946 40.6-150.4-105.1 120.1 18.9 43.4 93.7 26 26 A T > - 0 0 16 4,-3.0 3,-2.0 -2,-0.6 -22,-0.1 -0.097 32.2 -84.9 -85.2-176.0 20.3 39.9 94.1 27 27 A H T 3 S+ 0 0 142 1,-0.3 -1,-0.1 2,-0.1 -23,-0.1 0.614 127.9 57.6 -62.9 -14.4 20.4 37.3 96.8 28 28 A T T 3 S- 0 0 61 2,-0.2 -1,-0.3 0, 0.0 3,-0.1 0.472 115.7-115.1 -95.3 -3.6 23.5 39.1 98.1 29 29 A G S < S+ 0 0 39 -3,-2.0 2,-0.1 1,-0.3 -2,-0.1 0.403 81.1 117.8 84.9 -3.4 21.6 42.3 98.5 30 30 A R - 0 0 176 1,-0.1 -4,-3.0 -5,-0.1 -1,-0.3 -0.474 67.2-106.7 -92.5 166.5 23.8 43.9 95.9 31 31 A E E +B 25 0A 82 -6,-0.2 2,-0.3 -2,-0.1 -6,-0.2 -0.660 35.3 174.9 -96.1 151.1 22.8 45.3 92.5 32 32 A L E -B 24 0A 60 -8,-2.1 -8,-3.0 -2,-0.3 2,-0.6 -0.986 27.3-131.1-150.9 147.1 23.4 43.6 89.2 33 33 A T E -B 23 0A 65 -2,-0.3 2,-0.5 -10,-0.2 -10,-0.2 -0.924 24.7-168.0-104.2 121.6 22.4 44.4 85.6 34 34 A Y E -B 22 0A 76 -12,-3.2 -12,-3.3 -2,-0.6 2,-0.5 -0.944 4.3-158.5-114.5 128.8 21.0 41.4 83.7 35 35 A V E +B 21 0A 68 -2,-0.5 2,-0.3 -14,-0.2 -14,-0.2 -0.879 28.3 140.6-107.3 131.3 20.5 41.5 79.9 36 36 A Y E -B 20 0A 46 -16,-2.4 -16,-2.9 -2,-0.5 79,-0.2 -0.989 56.6-102.4-162.3 168.9 18.1 39.1 78.3 37 37 A R B -c 115 0B 50 77,-2.4 79,-2.4 -2,-0.3 80,-0.3 -0.902 52.9-137.5 -96.9 110.9 15.4 38.3 75.7 38 38 A P - 0 0 10 0, 0.0 -20,-0.1 0, 0.0 79,-0.1 -0.263 26.6 -97.8 -72.7 157.1 12.2 38.4 77.8 39 39 A G S S+ 0 0 32 1,-0.1 2,-0.1 77,-0.1 78,-0.1 -0.430 81.5 80.8-102.7-177.5 9.3 36.0 77.7 40 40 A P S S+ 0 0 143 0, 0.0 2,-0.3 0, 0.0 77,-0.1 0.405 77.0 126.2 -78.9 135.1 6.7 34.7 77.2 41 41 A V + 0 0 21 75,-0.3 77,-1.6 -4,-0.1 2,-0.3 -0.985 27.9 172.3-155.1 145.8 8.1 33.6 73.8 42 42 A A E -d 118 0C 17 35,-0.4 35,-2.7 -2,-0.3 2,-0.3 -0.961 17.2-157.4-152.2 166.5 8.5 30.2 72.1 43 43 A A E -dE 119 76C 11 75,-1.9 77,-2.8 -2,-0.3 2,-0.4 -0.968 17.3-135.7-143.5 153.8 9.4 28.3 68.9 44 44 A S E -dE 120 75C 0 31,-2.6 31,-2.2 -2,-0.3 2,-0.4 -0.926 12.5-163.1-116.1 141.9 8.4 24.9 67.6 45 45 A F E -dE 121 74C 14 75,-2.5 77,-1.8 -2,-0.4 2,-0.4 -0.955 7.9-168.2-121.2 137.6 10.8 22.4 66.0 46 46 A V E -d 122 0C 1 27,-2.6 77,-0.2 -2,-0.4 -2,-0.0 -0.966 18.9-154.3-138.8 123.0 9.6 19.4 64.0 47 47 A L E -d 123 0C 0 75,-2.9 77,-3.0 -2,-0.4 2,-0.8 -0.844 24.2-155.1 -88.6 108.4 11.4 16.3 62.7 48 48 A P E -d 124 0C 0 0, 0.0 8,-2.5 0, 0.0 2,-0.4 -0.790 12.2-171.9 -92.0 110.5 9.4 15.4 59.6 49 49 A V B -H 55 0D 1 75,-2.9 78,-2.6 -2,-0.8 77,-0.4 -0.856 10.5-144.3-106.8 134.6 9.7 11.7 58.8 50 50 A T > - 0 0 5 4,-2.7 3,-1.3 -2,-0.4 76,-0.1 -0.303 30.4-105.8 -86.3 173.0 8.3 10.2 55.6 51 51 A E T 3 S+ 0 0 123 76,-0.4 -1,-0.1 1,-0.3 77,-0.1 0.648 118.8 65.0 -74.5 -11.1 6.7 6.8 55.2 52 52 A R T 3 S- 0 0 170 2,-0.1 -1,-0.3 0, 0.0 3,-0.1 0.195 120.1-105.8 -93.8 14.1 9.9 5.8 53.4 53 53 A G S < S+ 0 0 18 -3,-1.3 95,-2.5 1,-0.2 96,-0.3 0.826 81.7 122.4 68.0 29.0 12.0 6.3 56.5 54 54 A T E - I 0 147D 18 93,-0.3 -4,-2.7 94,-0.1 2,-0.4 -0.770 54.0-132.1-115.7 166.2 13.6 9.5 55.4 55 55 A A E -HI 49 146D 0 91,-2.7 91,-2.0 -2,-0.3 2,-0.7 -0.939 8.4-135.0-121.1 144.2 13.6 12.9 57.0 56 56 A L E + I 0 145D 8 -8,-2.5 89,-0.2 -2,-0.4 2,-0.2 -0.874 40.4 164.9 -98.5 112.4 12.8 16.3 55.5 57 57 A L E - I 0 144D 2 87,-2.2 87,-2.5 -2,-0.7 2,-0.3 -0.624 29.0-127.2-120.3 177.9 15.4 18.8 56.7 58 58 A V E -JI 71 143D 0 13,-2.7 13,-2.8 85,-0.3 2,-0.7 -0.951 3.5-148.2-128.8 149.5 16.7 22.2 55.8 59 59 A R E -JI 70 142D 111 83,-2.8 83,-1.7 -2,-0.3 2,-0.4 -0.964 38.6-178.1-113.3 107.3 20.2 23.5 55.1 60 60 A Q E -JI 69 141D 5 9,-2.7 9,-2.9 -2,-0.7 2,-0.3 -0.914 31.8-123.2-123.1 134.9 19.9 27.1 56.5 61 61 A Y E -J 68 0D 74 79,-2.9 2,-0.6 -2,-0.4 79,-0.4 -0.538 23.0-167.3 -70.0 128.6 22.1 30.1 56.7 62 62 A R E >>> -J 67 0D 88 5,-2.8 3,-1.7 -2,-0.3 4,-1.3 -0.888 7.2-158.1-119.9 97.0 22.4 31.3 60.3 63 63 A H T 345S+ 0 0 135 -2,-0.6 3,-0.4 1,-0.3 -1,-0.1 0.801 84.3 59.6 -46.4 -45.7 24.0 34.7 60.1 64 64 A P T 345S+ 0 0 129 0, 0.0 -1,-0.3 0, 0.0 -2,-0.0 0.818 116.2 36.6 -56.6 -29.2 25.5 34.9 63.7 65 65 A T T <45S- 0 0 70 -3,-1.7 -2,-0.2 2,-0.2 3,-0.1 0.616 99.4-135.1 -96.3 -16.8 27.6 31.8 62.9 66 66 A G T <5 + 0 0 50 -4,-1.3 2,-0.3 -3,-0.4 -3,-0.2 0.601 69.2 111.9 70.3 11.5 28.3 32.6 59.3 67 67 A K E - 0 0 76 -2,-0.5 3,-2.2 4,-0.2 8,-0.1 -0.313 38.4 -70.9 -75.4 163.6 3.0 33.5 66.7 79 79 A E T 3 S+ 0 0 191 1,-0.3 -1,-0.2 -2,-0.0 3,-0.1 -0.268 120.1 4.1 -55.1 131.5 0.8 35.3 69.2 80 80 A G T 3 S+ 0 0 90 1,-0.2 2,-0.3 -3,-0.1 -1,-0.3 0.554 101.7 124.6 70.8 7.5 -2.1 33.1 70.2 81 81 A E < - 0 0 46 -3,-2.2 -1,-0.2 1,-0.0 -4,-0.0 -0.752 60.5-123.5 -98.7 145.6 -0.9 30.2 68.2 82 82 A T > - 0 0 81 -2,-0.3 4,-2.3 1,-0.1 5,-0.2 -0.483 24.0-114.2 -82.2 159.7 -0.4 26.7 69.8 83 83 A P H > S+ 0 0 43 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.897 117.5 52.3 -61.9 -36.6 3.0 25.0 69.5 84 84 A E H > S+ 0 0 85 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.919 108.8 49.6 -65.7 -40.3 1.6 22.3 67.3 85 85 A A H > S+ 0 0 39 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.892 111.0 49.5 -64.6 -40.1 0.0 24.8 64.9 86 86 A A H X S+ 0 0 0 -4,-2.3 4,-3.0 2,-0.2 5,-0.3 0.887 109.2 53.4 -64.4 -38.0 3.3 26.6 64.7 87 87 A A H X S+ 0 0 0 -4,-2.2 4,-1.9 -5,-0.2 -2,-0.2 0.952 112.5 42.8 -62.0 -48.9 5.1 23.3 64.0 88 88 A R H X S+ 0 0 88 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.918 115.3 50.5 -64.4 -40.2 2.7 22.5 61.1 89 89 A R H X S+ 0 0 54 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.930 112.0 45.0 -65.1 -46.6 2.9 26.1 59.8 90 90 A E H X S+ 0 0 9 -4,-3.0 4,-2.8 2,-0.2 5,-0.4 0.847 110.2 55.8 -67.1 -30.9 6.6 26.3 59.7 91 91 A L H X>S+ 0 0 2 -4,-1.9 4,-2.0 -5,-0.3 6,-1.5 0.927 111.7 44.0 -64.8 -41.5 6.9 22.8 58.2 92 92 A R H X5S+ 0 0 110 -4,-2.1 4,-0.9 4,-0.3 -2,-0.2 0.913 117.0 45.9 -69.2 -42.1 4.6 24.0 55.3 93 93 A E H <5S+ 0 0 39 -4,-2.7 41,-2.5 40,-0.2 -2,-0.2 0.935 121.3 34.3 -66.9 -47.8 6.5 27.3 55.0 94 94 A E H <5S+ 0 0 2 -4,-2.8 -2,-0.2 39,-0.2 -3,-0.2 0.836 137.8 14.2 -82.0 -32.2 10.0 26.0 55.0 95 95 A V H <5S- 0 0 4 -4,-2.0 -3,-0.2 -5,-0.4 36,-0.2 0.473 92.6-121.9-120.4 -8.9 9.7 22.6 53.3 96 96 A G << + 0 0 0 -4,-0.9 34,-3.1 -5,-0.7 35,-1.9 0.771 68.9 135.4 69.7 27.1 6.3 22.9 51.6 97 97 A A E -K 129 0E 0 -6,-1.5 2,-0.3 32,-0.3 32,-0.2 -0.704 42.0-163.9-113.4 160.0 5.2 19.8 53.6 98 98 A E E -K 128 0E 92 30,-2.4 30,-2.5 -2,-0.2 2,-0.3 -0.872 12.6-167.3-129.6 162.1 2.3 18.5 55.6 99 99 A A - 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